1-[2-(4-methoxyphenyl)-4-naphthalen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-morpholin-4-yl-pentan-1-one

Systemtic Name: 1-[2-(4-methoxyphenyl)-4-naphthalen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-morpholin-4-yl-pentan-1-one Openeye Name: 1-[2-(4-methoxyphenyl)-4-(2-naphthyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-morpholino-pentan-1-one CAS Name: 1-[2-(4-methoxyphenyl)-4-(2-naphthalenyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-(4-morpholinyl)-1-pentanone IUPAC Name: 1-[2-(4-methoxyphenyl)-4-naphthalen-2-yl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-morpholin-4-ylpentan-1-one Traditional Name: 1-[2-(4-methoxyphenyl)-4-(2-naphthyl)-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-5-morpholino-pentan-1-one Formula: C35H38N2O3S MolecularWeight: 566.75282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(N(C3=CC=CC=C3S2)C(=O)CCCCN4CCOCC4)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(N(C3=CC=CC=C3S2)C(=O)CCCCN4CCOCC4)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C35H38N2O3S/c1-39-30-17-15-27(16-18-30)34-25-32(29-14-13-26-8-2-3-9-28(26)24-29)37(31-10-4-5-11-33(31)41-34)35(38)12-6-7-19-36-20-22-40-23-21-36/h2-5,8-11,13-18,24,32,34H,6-7,12,19-23,25H2,1H3